!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!! !!!!! !!!!! VERIFICATION CHECK: vc-memory-leak !!!!! !!!!! !!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! Description: Check that the model has no memory leaks. This is tested using the Valgrind memory debugging tool (http://valgrind.org) by performing a series of energy and force calculations on a randomly distorted face-centered cubic (FCC) cube base structure for both non-periodic and periodic boundary conditions. Separate configurations are tested for each species supported by the model, as well as one containing a random distribution of all species. Configurations used for testing are provided as auxiliary files. Author: Ellad Tadmor and Daniel S. Karls ----------------------------------------------------------------------------------------------------- Results for KIM Model : MEAM_LAMMPS_JeongParkDo_2018_PdNi__MO_008996216289_000 Supported species : Ni Pd random seed = 13 lattice constant (orig) = 3.000 perturbation amplitude = 0.300 number unit cells per side = 2 ----------------------------------------------------------------------------------------------------- MONOATOMIC STRUCTURE (pbc=False)-- Species = Ni (Configuration in file "config-F-Ni.xyz") ----------------------------------------------------------------------------------------------------- Energy = -10.083194438293354 Forces: 1 -3.78162623e+00 -7.47941322e+00 -8.11197329e+00 2 -6.18708421e+00 9.42600713e+00 -4.01636276e+00 3 6.40345826e+00 -7.35816313e+00 -4.02119608e+00 4 -6.39942036e+00 5.31560516e+00 5.28893630e+00 5 2.56847285e+00 -1.50701443e+01 -5.01424782e-01 6 6.85856813e+00 7.28230951e+00 -6.22066672e+00 7 2.33472129e+00 -3.06045717e+01 -2.68678704e+01 8 -1.46493541e+01 -1.11081643e+01 -4.57685983e+00 9 -1.00935852e+01 -6.21569087e+00 -1.51749132e+01 10 -6.62541727e+00 1.86392510e+01 -1.89926911e+01 11 -3.35370269e+00 -1.21285065e+01 1.58254733e+01 12 -6.18684207e+00 8.40123087e+00 7.25874082e+00 13 -6.09863434e+00 -1.31538907e+01 -3.77455380e+01 14 5.22675125e+00 7.95683451e+00 -4.92193135e+00 15 3.35448808e+01 -6.14756278e+00 1.25654240e+01 16 7.34169100e+00 2.37945602e+01 1.41365760e+01 17 -1.17906106e+01 -5.85191306e+00 -4.51707623e+00 18 3.74367127e+00 1.09997279e+01 -3.08921527e+00 19 2.37914625e+00 -1.34442139e+01 7.33233878e+00 20 -4.32682825e+00 7.08237520e+00 6.19604506e+00 21 -1.29349006e+01 -9.64050163e+00 7.34192981e+00 22 2.12829084e+01 2.90156539e+01 2.13340148e+01 23 2.36297757e+00 -1.38388060e+00 7.14949645e+00 24 6.33941635e+00 5.54625739e+00 5.25564339e+00 25 -1.02244704e+01 -1.18629586e+01 -1.69410089e+01 26 -4.51457245e+00 1.32680993e+01 -1.06995903e+01 27 1.93569078e+01 -3.11103213e+01 1.45786871e+01 28 -2.81632989e+01 2.92889173e+01 1.32262987e+01 29 -8.45579697e+00 -7.81114473e+00 5.75685393e+00 30 5.62141594e+00 1.04839432e+01 -1.07417386e-01 31 1.13022763e+01 -9.84552797e+00 9.95771042e+00 32 7.11888107e+00 1.37157967e+01 1.33015668e+01 MONOATOMIC STRUCTURE (pbc=True)-- Species = Ni (Configuration in file "config-T-Ni.xyz") ----------------------------------------------------------------------------------------------------- Energy = -10.083194438293354 Forces: 1 -3.78162623e+00 -7.47941322e+00 -8.11197329e+00 2 -6.18708421e+00 9.42600713e+00 -4.01636276e+00 3 6.40345826e+00 -7.35816313e+00 -4.02119608e+00 4 -6.39942036e+00 5.31560516e+00 5.28893630e+00 5 2.56847285e+00 -1.50701443e+01 -5.01424782e-01 6 6.85856813e+00 7.28230951e+00 -6.22066672e+00 7 2.33472129e+00 -3.06045717e+01 -2.68678704e+01 8 -1.46493541e+01 -1.11081643e+01 -4.57685983e+00 9 -1.00935852e+01 -6.21569087e+00 -1.51749132e+01 10 -6.62541727e+00 1.86392510e+01 -1.89926911e+01 11 -3.35370269e+00 -1.21285065e+01 1.58254733e+01 12 -6.18684207e+00 8.40123087e+00 7.25874082e+00 13 -6.09863434e+00 -1.31538907e+01 -3.77455380e+01 14 5.22675125e+00 7.95683451e+00 -4.92193135e+00 15 3.35448808e+01 -6.14756278e+00 1.25654240e+01 16 7.34169100e+00 2.37945602e+01 1.41365760e+01 17 -1.17906106e+01 -5.85191306e+00 -4.51707623e+00 18 3.74367127e+00 1.09997279e+01 -3.08921527e+00 19 2.37914625e+00 -1.34442139e+01 7.33233878e+00 20 -4.32682825e+00 7.08237520e+00 6.19604506e+00 21 -1.29349006e+01 -9.64050163e+00 7.34192981e+00 22 2.12829084e+01 2.90156539e+01 2.13340148e+01 23 2.36297757e+00 -1.38388060e+00 7.14949645e+00 24 6.33941635e+00 5.54625739e+00 5.25564339e+00 25 -1.02244704e+01 -1.18629586e+01 -1.69410089e+01 26 -4.51457245e+00 1.32680993e+01 -1.06995903e+01 27 1.93569078e+01 -3.11103213e+01 1.45786871e+01 28 -2.81632989e+01 2.92889173e+01 1.32262987e+01 29 -8.45579697e+00 -7.81114473e+00 5.75685393e+00 30 5.62141594e+00 1.04839432e+01 -1.07417386e-01 31 1.13022763e+01 -9.84552797e+00 9.95771042e+00 32 7.11888107e+00 1.37157967e+01 1.33015668e+01 MONOATOMIC STRUCTURE (pbc=False)-- Species = Pd (Configuration in file "config-F-Pd.xyz") ----------------------------------------------------------------------------------------------------- Energy = 272.45437365932037 Forces: 1 -1.42691677e+01 -2.43934789e+01 -1.73415774e+01 2 3.09621861e+01 1.48324764e+01 -6.42152312e+01 3 2.87337930e+00 -5.80345426e+01 -3.77409423e+00 4 -6.89896913e+01 3.72030212e+01 1.13297430e+01 5 7.59758184e+00 -1.78205399e+01 -2.65282222e+01 6 2.10766071e+01 -7.97028309e+00 -1.23467046e+01 7 1.26510043e+01 -8.73676897e+00 -3.55436218e+00 8 2.85724668e+01 3.41990672e+01 1.62434869e+01 9 -4.28429531e+01 -2.32154487e+01 -3.08403033e+01 10 4.84952161e+01 3.63515322e+01 -7.16004549e+01 11 8.15428921e+01 -6.28139305e+01 1.54447492e+01 12 -1.05430464e+02 8.63254821e+01 5.94894069e+01 13 8.55440668e+00 1.70440098e+01 -2.33773010e+01 14 5.00783807e+00 8.47563636e+00 -1.04741495e+01 15 1.44819846e+01 2.75373036e+01 -3.17020736e+01 16 4.22847188e+01 3.23652380e+00 -3.73884226e+01 17 -5.60843496e+01 -6.16615642e+01 4.38048385e+01 18 6.99263198e+01 -7.32616170e+01 -9.56747165e+01 19 7.50628999e+00 -1.84045180e+01 2.16448822e+01 20 -9.52398272e+01 -4.89954971e+01 6.73860673e+01 21 -1.79320586e+01 -8.53235968e+01 -7.28876365e+01 22 1.64191703e+01 -3.25981338e+01 2.56740210e+01 23 3.37025474e+01 -1.59288289e+01 2.31187057e+01 24 -2.45353129e+01 8.14598183e+01 8.41377438e+01 25 -3.58249852e+01 2.21964145e+01 -4.21832514e+01 26 -4.30405306e+01 2.52656609e+01 4.27382051e+01 27 6.92546763e+01 9.61143882e+01 9.13766901e+01 28 -1.74142539e+01 3.12477179e+01 2.81300300e+01 29 -3.49299584e+01 -3.31606863e+01 -2.48623141e+01 30 3.98115349e+01 4.12718569e+01 -8.94007174e+00 31 2.40152782e+01 -8.63106999e+00 2.49777237e+01 32 -8.20254615e+00 1.81895953e+01 2.21945935e+01 MONOATOMIC STRUCTURE (pbc=True)-- Species = Pd (Configuration in file "config-T-Pd.xyz") ----------------------------------------------------------------------------------------------------- Energy = 272.45437365932037 Forces: 1 -1.42691677e+01 -2.43934789e+01 -1.73415774e+01 2 3.09621861e+01 1.48324764e+01 -6.42152312e+01 3 2.87337930e+00 -5.80345426e+01 -3.77409423e+00 4 -6.89896913e+01 3.72030212e+01 1.13297430e+01 5 7.59758184e+00 -1.78205399e+01 -2.65282222e+01 6 2.10766071e+01 -7.97028309e+00 -1.23467046e+01 7 1.26510043e+01 -8.73676897e+00 -3.55436218e+00 8 2.85724668e+01 3.41990672e+01 1.62434869e+01 9 -4.28429531e+01 -2.32154487e+01 -3.08403033e+01 10 4.84952161e+01 3.63515322e+01 -7.16004549e+01 11 8.15428921e+01 -6.28139305e+01 1.54447492e+01 12 -1.05430464e+02 8.63254821e+01 5.94894069e+01 13 8.55440668e+00 1.70440098e+01 -2.33773010e+01 14 5.00783807e+00 8.47563636e+00 -1.04741495e+01 15 1.44819846e+01 2.75373036e+01 -3.17020736e+01 16 4.22847188e+01 3.23652380e+00 -3.73884226e+01 17 -5.60843496e+01 -6.16615642e+01 4.38048385e+01 18 6.99263198e+01 -7.32616170e+01 -9.56747165e+01 19 7.50628999e+00 -1.84045180e+01 2.16448822e+01 20 -9.52398272e+01 -4.89954971e+01 6.73860673e+01 21 -1.79320586e+01 -8.53235968e+01 -7.28876365e+01 22 1.64191703e+01 -3.25981338e+01 2.56740210e+01 23 3.37025474e+01 -1.59288289e+01 2.31187057e+01 24 -2.45353129e+01 8.14598183e+01 8.41377438e+01 25 -3.58249852e+01 2.21964145e+01 -4.21832514e+01 26 -4.30405306e+01 2.52656609e+01 4.27382051e+01 27 6.92546763e+01 9.61143882e+01 9.13766901e+01 28 -1.74142539e+01 3.12477179e+01 2.81300300e+01 29 -3.49299584e+01 -3.31606863e+01 -2.48623141e+01 30 3.98115349e+01 4.12718569e+01 -8.94007174e+00 31 2.40152782e+01 -8.63106999e+00 2.49777237e+01 32 -8.20254615e+00 1.81895953e+01 2.21945935e+01 MIXED STRUCTURE (pbc=False)-- Species = Ni Pd (Configuration in file "config-F-NiPd.xyz") ----------------------------------------------------------------------------------------------------- Energy = 171.34961483849935 Forces: 1 -7.46418828e+01 -7.93449926e+01 -2.49687050e+00 2 6.17149314e+01 8.59997512e+01 -3.60382914e+01 3 -2.91527143e+01 -1.10731332e+01 4.04248750e+01 4 -2.16328180e+01 5.43476153e+00 1.81444537e+01 5 4.89088215e+01 -2.74088297e+01 -3.83282290e+01 6 1.33480091e+01 2.09349949e+01 -4.54898578e+01 7 3.43771538e+01 -4.49559002e+01 5.99289587e+00 8 -1.01323416e+01 -7.26585651e-01 3.63055761e+00 9 -1.58168088e+01 1.66939505e+00 -9.03606399e+00 10 -2.58580015e+01 3.48929295e+01 -4.39511670e+01 11 -4.51184214e+01 -3.65848816e+01 -2.85550938e+01 12 -1.75856924e+01 1.60681315e+01 4.58877968e+00 13 2.92742871e+01 -2.95312391e+01 -3.10915106e+01 14 7.87692163e+00 5.08935339e+00 -2.76316603e+00 15 2.26536883e+01 1.35628980e+01 2.82477410e+00 16 1.97641419e+01 3.93161014e+01 9.81817495e+00 17 -6.26905262e+01 -6.94986311e+01 -5.89848747e+01 18 1.63861680e+01 2.18829460e+01 -3.82215685e+01 19 5.37549130e+01 -4.37530674e+01 5.65379013e+01 20 -3.27826537e+01 5.25444350e+01 4.95917640e+01 21 -2.41966909e+01 -1.74020100e+01 6.86835520e+00 22 3.82974765e+01 8.61125328e+00 -6.61809580e+00 23 2.59146096e+01 -3.50722748e+01 1.35893620e+01 24 -3.95313194e+01 3.38398491e+01 3.02653997e+01 25 -2.14896127e+01 3.25310410e-01 1.42776249e+01 26 -2.66957262e+01 1.84390312e+01 -9.35834693e+00 27 6.83893429e-01 -4.94710067e+00 8.57233769e+00 28 -1.73172174e+01 1.30889359e+01 9.43101901e+00 29 4.70124468e+01 -1.69212798e+01 1.64932979e+01 30 1.03267189e+01 7.28839012e+00 -6.85275227e+00 31 1.04626983e+01 5.38008716e+00 8.23443114e+00 32 2.38855480e+01 3.28513711e+01 5.84998844e+01 MIXED STRUCTURE (pbc=True)-- Species = Ni Pd (Configuration in file "config-T-NiPd.xyz") ----------------------------------------------------------------------------------------------------- Energy = 239.07269819450954 Forces: 1 -5.79879766e+01 -7.28686557e+01 2.59361833e+00 2 5.85593355e+01 8.73125010e+01 -9.90232331e+00 3 -2.72244938e+01 -4.76403934e+00 3.79818690e+01 4 3.39665855e+01 1.73969801e+01 2.46540918e+01 5 2.95485436e+01 -4.06168952e+00 -2.82238384e+01 6 -1.76536802e+01 2.90751229e+01 -4.65351614e+01 7 -1.55315407e+01 -6.30483928e+01 7.20326114e+00 8 -8.20688325e+00 -1.03663244e+00 1.64430496e+00 9 -1.01269008e+00 3.09325130e+00 -1.28353753e+01 10 -6.86896449e+00 3.50782312e+01 -1.82360665e+01 11 -4.42406286e+01 -3.58568747e+01 -2.90090553e+01 12 -1.19410135e+01 1.47725224e+01 5.72651562e+00 13 2.87313314e+01 -3.11561638e+01 -2.51651684e+01 14 1.54204601e+01 -2.06979104e+01 8.87677623e+00 15 -2.60285446e+01 1.60501610e+01 -7.73317088e+00 16 2.01232996e+01 2.40612449e+01 1.72200411e+01 17 -4.32976210e+01 -6.03304980e+01 -5.42995846e+01 18 1.59240295e+01 2.00472925e+01 -3.65458441e+01 19 5.65452288e+01 -4.36687899e+01 3.87871457e+01 20 -3.12085059e+01 5.45480250e+01 3.74025513e+01 21 -2.28354246e+01 -1.33186269e+01 5.64198365e+00 22 3.31038592e+01 6.39910720e+00 -6.54813131e+00 23 2.82677026e+01 -2.52414699e+01 -1.59677043e+01 24 -4.17061223e+01 3.30269993e+01 2.82211782e+01 25 1.01073159e+01 -6.24929978e-01 3.35415964e+01 26 -2.53841006e+01 1.23845238e+01 -1.03046116e+01 27 -2.08948930e+00 -5.36708597e+00 6.65462720e-01 28 -2.17504942e+01 1.56576516e+01 -1.09563541e+01 29 4.72980151e+01 -1.88587520e+01 1.71156368e+01 30 3.16818997e+00 3.04006431e+00 -9.29918260e+00 31 2.02315574e+00 2.76701695e+00 5.82050207e+00 32 2.21811213e+01 2.61898159e+01 4.84650371e+01 ================================================================================ VALGRIND OUTPUT ================================================================================ ==18510== Memcheck, a memory error detector ==18510== Copyright (C) 2002-2017, and GNU GPL'd, by Julian Seward et al. ==18510== Using Valgrind-3.13.0 and LibVEX; rerun with -h for copyright info ==18510== Command: python runner2.py MEAM_LAMMPS_JeongParkDo_2018_PdNi__MO_008996216289_000 ==18510== ==18510== Conditional jump or move depends on uninitialised value(s) ==18510== at 0x4FCDC2C: __wcsnlen_avx2 (strlen-avx2.S:106) ==18510== by 0x4EFBCA1: wcsrtombs (wcsrtombs.c:104) ==18510== by 0x4E81C40: wcstombs (wcstombs.c:34) ==18510== by 0x5471CF: ??? (in /usr/bin/python3.6) ==18510== by 0x6330AD: _Py_stat (in /usr/bin/python3.6) ==18510== by 0x5B9C10: ??? (in /usr/bin/python3.6) ==18510== by 0x5515C0: ??? (in /usr/bin/python3.6) ==18510== by 0x5A9DAB: _PyObject_FastCallKeywords (in /usr/bin/python3.6) ==18510== by 0x50A432: ??? (in /usr/bin/python3.6) ==18510== by 0x50BEB3: _PyEval_EvalFrameDefault (in /usr/bin/python3.6) ==18510== by 0x5095C7: ??? (in /usr/bin/python3.6) ==18510== by 0x50A2FC: ??? (in /usr/bin/python3.6) ==18510== ==18510== Conditional jump or move depends on uninitialised value(s) ==18510== at 0x4E654E8: internal_utf8_loop (loop.c:298) ==18510== by 0x4E654E8: __gconv_transform_internal_utf8 (skeleton.c:609) ==18510== by 0x4EFBCD4: wcsrtombs (wcsrtombs.c:110) ==18510== by 0x4E81C40: wcstombs (wcstombs.c:34) ==18510== by 0x5471CF: ??? (in /usr/bin/python3.6) ==18510== by 0x6330AD: _Py_stat (in /usr/bin/python3.6) ==18510== by 0x5B9C10: ??? (in /usr/bin/python3.6) ==18510== by 0x5515C0: ??? (in /usr/bin/python3.6) ==18510== by 0x5A9DAB: _PyObject_FastCallKeywords (in /usr/bin/python3.6) ==18510== by 0x50A432: ??? (in /usr/bin/python3.6) ==18510== by 0x50BEB3: _PyEval_EvalFrameDefault (in /usr/bin/python3.6) ==18510== by 0x5095C7: ??? (in /usr/bin/python3.6) ==18510== by 0x50A2FC: ??? (in /usr/bin/python3.6) ==18510== ==18510== Conditional jump or move depends on uninitialised value(s) ==18510== at 0x4E654F1: internal_utf8_loop (loop.c:303) ==18510== by 0x4E654F1: __gconv_transform_internal_utf8 (skeleton.c:609) ==18510== by 0x4EFBCD4: wcsrtombs (wcsrtombs.c:110) ==18510== by 0x4E81C40: wcstombs (wcstombs.c:34) ==18510== by 0x5471CF: ??? (in /usr/bin/python3.6) ==18510== by 0x6330AD: _Py_stat (in /usr/bin/python3.6) ==18510== by 0x5B9C10: ??? (in /usr/bin/python3.6) ==18510== by 0x5515C0: ??? (in /usr/bin/python3.6) ==18510== by 0x5A9DAB: _PyObject_FastCallKeywords (in /usr/bin/python3.6) ==18510== by 0x50A432: ??? (in /usr/bin/python3.6) ==18510== by 0x50BEB3: _PyEval_EvalFrameDefault (in /usr/bin/python3.6) ==18510== by 0x5095C7: ??? (in /usr/bin/python3.6) ==18510== by 0x50A2FC: ??? (in /usr/bin/python3.6) ==18510== ==18510== Conditional jump or move depends on uninitialised value(s) ==18510== at 0x4E65538: internal_utf8_loop (loop.c:298) ==18510== by 0x4E65538: __gconv_transform_internal_utf8 (skeleton.c:609) ==18510== by 0x4EFBCD4: wcsrtombs (wcsrtombs.c:110) ==18510== by 0x4E81C40: wcstombs (wcstombs.c:34) ==18510== by 0x5471CF: ??? (in /usr/bin/python3.6) ==18510== by 0x6330AD: _Py_stat (in /usr/bin/python3.6) ==18510== by 0x5B9C10: ??? (in /usr/bin/python3.6) ==18510== by 0x5515C0: ??? (in /usr/bin/python3.6) ==18510== by 0x5A9DAB: _PyObject_FastCallKeywords (in /usr/bin/python3.6) ==18510== by 0x50A432: ??? (in /usr/bin/python3.6) ==18510== by 0x50BEB3: _PyEval_EvalFrameDefault (in /usr/bin/python3.6) ==18510== by 0x5095C7: ??? (in /usr/bin/python3.6) ==18510== by 0x50A2FC: ??? (in /usr/bin/python3.6) ==18510== ==18510== Conditional jump or move depends on uninitialised value(s) ==18510== at 0x4FCDDB7: __wcsnlen_avx2 (strlen-avx2.S:264) ==18510== by 0x4EFBCA1: wcsrtombs (wcsrtombs.c:104) ==18510== by 0x4E81C40: wcstombs (wcstombs.c:34) ==18510== by 0x5471CF: ??? (in /usr/bin/python3.6) ==18510== by 0x5474B0: PyUnicode_FSConverter (in /usr/bin/python3.6) ==18510== by 0x4C4D46: ??? (in /usr/bin/python3.6) ==18510== by 0x4F7E48: ??? (in /usr/bin/python3.6) ==18510== by 0x4FB843: ??? (in /usr/bin/python3.6) ==18510== by 0x4FC3D4: _PyArg_ParseStack_SizeT (in /usr/bin/python3.6) ==18510== by 0x4C6448: ??? (in /usr/bin/python3.6) ==18510== by 0x50A259: ??? (in /usr/bin/python3.6) ==18510== by 0x50BEB3: _PyEval_EvalFrameDefault (in /usr/bin/python3.6) ==18510== ==18510== Mismatched free() / delete / delete [] ==18510== at 0x4C3323B: operator delete(void*) (in /usr/lib/valgrind/vgpreload_memcheck-amd64-linux.so) ==18510== by 0x7E57A600: MEAMC::ProcessLibraryFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x7E45C83F: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x7E45ECF6: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x7E440A01: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x7E441E8D: ModelDriverCreateRoutine (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x78A59DDF: KIM::ModelImplementation::InitializeParameterizedModel(KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, KIM::Collections*) (in /usr/local/lib/libkim-api.so.2.2.1) ==18510== by 0x78A5AF90: KIM::ModelImplementation::ModelCreate(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&) (in /usr/local/lib/libkim-api.so.2.2.1) ==18510== by 0x78A5F20A: KIM::ModelImplementation::Create(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, int*, KIM::ModelImplementation**) (in /usr/local/lib/libkim-api.so.2.2.1) ==18510== by 0x78A13960: KIM::Model::Create(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, int*, KIM::Model**) (in /usr/local/lib/libkim-api.so.2.2.1) ==18510== by 0x78792CC7: void pybind11::cpp_function::initialize, std::allocator > const&)#15}, pybind11::tuple, KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, pybind11::arg, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, char [45]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&)#15}&&, pybind11::tuple (*)(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, pybind11::arg const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, char const (&) [45])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:314) ==18510== by 0x787A191A: pybind11::cpp_function::dispatcher(_object*, _object*, _object*) (pybind11.h:767) ==18510== Address 0x55b58b00 is 0 bytes inside a block of size 1,024 alloc'd ==18510== at 0x4C3289F: operator new[](unsigned long) (in /usr/lib/valgrind/vgpreload_memcheck-amd64-linux.so) ==18510== by 0x7E579C08: MEAMC::ProcessLibraryFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x7E45C83F: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x7E45ECF6: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x7E440A01: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x7E441E8D: ModelDriverCreateRoutine (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x78A59DDF: KIM::ModelImplementation::InitializeParameterizedModel(KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, KIM::Collections*) (in /usr/local/lib/libkim-api.so.2.2.1) ==18510== by 0x78A5AF90: KIM::ModelImplementation::ModelCreate(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&) (in /usr/local/lib/libkim-api.so.2.2.1) ==18510== by 0x78A5F20A: KIM::ModelImplementation::Create(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, int*, KIM::ModelImplementation**) (in /usr/local/lib/libkim-api.so.2.2.1) ==18510== by 0x78A13960: KIM::Model::Create(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, int*, KIM::Model**) (in /usr/local/lib/libkim-api.so.2.2.1) ==18510== by 0x78792CC7: void pybind11::cpp_function::initialize, std::allocator > const&)#15}, pybind11::tuple, KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, pybind11::arg, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, char [45]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&)#15}&&, pybind11::tuple (*)(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, pybind11::arg const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, char const (&) [45])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:314) ==18510== by 0x787A191A: pybind11::cpp_function::dispatcher(_object*, _object*, _object*) (pybind11.h:767) ==18510== ==18510== Mismatched free() / delete / delete [] ==18510== at 0x4C3323B: operator delete(void*) (in /usr/lib/valgrind/vgpreload_memcheck-amd64-linux.so) ==18510== by 0x7E574848: MEAMC::ProcessParameterFile(_IO_FILE*, int) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x7E45C86E: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x7E45ECF6: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x7E440A01: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x7E441E8D: ModelDriverCreateRoutine (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x78A59DDF: KIM::ModelImplementation::InitializeParameterizedModel(KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, KIM::Collections*) (in /usr/local/lib/libkim-api.so.2.2.1) ==18510== by 0x78A5AF90: KIM::ModelImplementation::ModelCreate(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&) (in /usr/local/lib/libkim-api.so.2.2.1) ==18510== by 0x78A5F20A: KIM::ModelImplementation::Create(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, int*, KIM::ModelImplementation**) (in /usr/local/lib/libkim-api.so.2.2.1) ==18510== by 0x78A13960: KIM::Model::Create(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, int*, KIM::Model**) (in /usr/local/lib/libkim-api.so.2.2.1) ==18510== by 0x78792CC7: void pybind11::cpp_function::initialize, std::allocator > const&)#15}, pybind11::tuple, KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, pybind11::arg, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, char [45]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&)#15}&&, pybind11::tuple (*)(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, pybind11::arg const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, char const (&) [45])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:314) ==18510== by 0x787A191A: pybind11::cpp_function::dispatcher(_object*, _object*, _object*) (pybind11.h:767) ==18510== Address 0x55b59d90 is 0 bytes inside a block of size 1,024 alloc'd ==18510== at 0x4C3289F: operator new[](unsigned long) (in /usr/lib/valgrind/vgpreload_memcheck-amd64-linux.so) ==18510== by 0x7E57464A: MEAMC::ProcessParameterFile(_IO_FILE*, int) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x7E45C86E: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x7E45ECF6: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x7E440A01: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x7E441E8D: ModelDriverCreateRoutine (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==18510== by 0x78A59DDF: KIM::ModelImplementation::InitializeParameterizedModel(KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, KIM::Collections*) (in /usr/local/lib/libkim-api.so.2.2.1) ==18510== by 0x78A5AF90: KIM::ModelImplementation::ModelCreate(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&) (in /usr/local/lib/libkim-api.so.2.2.1) ==18510== by 0x78A5F20A: KIM::ModelImplementation::Create(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, int*, KIM::ModelImplementation**) (in /usr/local/lib/libkim-api.so.2.2.1) ==18510== by 0x78A13960: KIM::Model::Create(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, int*, KIM::Model**) (in /usr/local/lib/libkim-api.so.2.2.1) ==18510== by 0x78792CC7: void pybind11::cpp_function::initialize, std::allocator > const&)#15}, pybind11::tuple, KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, pybind11::arg, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, char [45]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&)#15}&&, pybind11::tuple (*)(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, pybind11::arg const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, char const (&) [45])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:314) ==18510== by 0x787A191A: pybind11::cpp_function::dispatcher(_object*, _object*, _object*) (pybind11.h:767) ==18510== ==18510== ==18510== HEAP SUMMARY: ==18510== in use at exit: 2,776,687 bytes in 1,540 blocks ==18510== total heap usage: 92,301 allocs, 90,761 frees, 119,691,373 bytes allocated ==18510== ==18510== LEAK SUMMARY: ==18510== definitely lost: 0 bytes in 0 blocks ==18510== indirectly lost: 0 bytes in 0 blocks ==18510== possibly lost: 145,616 bytes in 85 blocks ==18510== still reachable: 2,631,071 bytes in 1,455 blocks ==18510== suppressed: 0 bytes in 0 blocks ==18510== Rerun with --leak-check=full to see details of leaked memory ==18510== ==18510== For counts of detected and suppressed errors, rerun with: -v ==18510== Use --track-origins=yes to see where uninitialised values come from ==18510== ERROR SUMMARY: 6692 errors from 7 contexts (suppressed: 12664 from 684) ================================================================================ To pass this verification check the number of bytes that are "definitely lost" or "indirectly lost" must be zero. NOTE that Valgrind will typically report non-zero "possibly lost" bytes due to Python's internal memory allocation and garbage collection that it does not monitor. Full Valgrind output written to auxiliary file "valgrind.out" Grade: P Comment: No memory leak detected.